2-chloro-N-(4-chloro-7,7-dimethyl-9-oxo-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
2-chloro-N-(4-chloro-7,7-dimethyl-9-oxo-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-5-nitrobenzene-1-sulfonamide
2-chloro-N-(4-chloro-7,7-dimethyl-9-oxo-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4456-0626 |
| Compound Name: | 2-chloro-N-(4-chloro-7,7-dimethyl-9-oxo-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 483.33 |
| Molecular Formula: | C20 H16 Cl2 N2 O6 S |
| Smiles: | CC1(C)CC(c2c3cc(cc(c3oc2C1)[Cl])NS(c1cc(ccc1[Cl])[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7564 |
| logD: | 2.4411 |
| logSw: | -5.0957 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.866 |
| InChI Key: | RNJUBYGWUQLQLC-UHFFFAOYSA-N |